Structure Information
Structure

Compound Identification

SMILES

OC(=O)\C=C\C(O)=O.CN(C)CC\C=C1\C2=CC=CC=C2SC2=C(O)C=C(Cl)C=C12

InChIKey

InChIKey=LGOSCZYIELLRNJ-CYISSEJGSA-N

Formula

C22H22ClNO5S

Mass

447.93

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiopyrans

Subclass

1-benzothiopyrans

Intermediate Tree Nodes

Not available

Direct Parent

Thioxanthenes

Alternative Parents

Molecular Framework

Not available

Substituents

Thioxanthene - Diarylthioether - 3-halophenol - Aryl thioether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Benzenoid - Fatty acid - Fatty acyl - Tertiary amine - Tertiary aliphatic amine - Thioether - Carboxylic acid derivative - Carboxylic acid - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Amine - Organic oxide - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thioxanthenes. These are organic polycyclic compounds containing a thioxanthene moiety, which is an aromatic tricycle derived from xanthene by replacing the oxygen atom with a sulfur atom.

External Descriptors

Not available

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